[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] N-(4-piperidin-1-ylsulfonylphenyl)carbamate

Systemtic Name: [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] N-(4-piperidin-1-ylsulfonylphenyl)carbamate Openeye Name: [17-(1,5-dimethylhexyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] N-[4-(1-piperidylsulfonyl)phenyl]carbamate CAS Name: N-[4-(1-piperidinylsulfonyl)phenyl]carbamic acid [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] ester IUPAC Name: [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] N-(4-piperidin-1-ylsulfonylphenyl)carbamate Traditional Name: N-(4-piperidinosulfonylphenyl)carbamic acid [17-(1,5-dimethylhexyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] ester Formula: C39H60N2O4S MolecularWeight: 652.9697

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)NC5=CC=C(C=C5)S(=O)(=O)N6CCCCC6)C)C

Isomeric SMILES

CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)NC5=CC=C(C=C5)S(=O)(=O)N6CCCCC6)C)C

InChI

InChI=1S/C39H60N2O4S/c1-27(2)10-9-11-28(3)34-18-19-35-33-17-12-29-26-31(20-22-38(29,4)36(33)21-23-39(34,35)5)45-37(42)40-30-13-15-32(16-14-30)46(43,44)41-24-7-6-8-25-41/h12-16,27-28,31,33-36H,6-11,17-26H2,1-5H3,(H,40,42)