N-[1-[azanyl-[2-(phenylsulfonyl)ethyl]carbamoyl]-3-heptyl-cyclohexyl]morpholine-4-carboxamide

Systemtic Name: N-[1-[azanyl-[2-(phenylsulfonyl)ethyl]carbamoyl]-3-heptyl-cyclohexyl]morpholine-4-carboxamide Openeye Name: N-[1-[amino-[2-(benzenesulfonyl)ethyl]carbamoyl]-3-heptyl-cyclohexyl]morpholine-4-carboxamide CAS Name: N-[1-[[amino-[2-(benzenesulfonyl)ethyl]amino]-oxomethyl]-3-heptylcyclohexyl]-4-morpholinecarboxamide IUPAC Name: N-[1-[amino-[2-(benzenesulfonyl)ethyl]carbamoyl]-3-heptylcyclohexyl]morpholine-4-carboxamide Traditional Name: N-[1-[amino(2-besylethyl)carbamoyl]-3-heptyl-cyclohexyl]morpholine-4-carboxamide Formula: C27H44N4O5S MolecularWeight: 536.72706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCCC(C1)(C(=O)N(CCS(=O)(=O)C2=CC=CC=C2)N)NC(=O)N3CCOCC3

Isomeric SMILES

CCCCCCCC1CCCC(C1)(C(=O)N(CCS(=O)(=O)C2=CC=CC=C2)N)NC(=O)N3CCOCC3

InChI

InChI=1S/C27H44N4O5S/c1-2-3-4-5-7-11-23-12-10-15-27(22-23,29-26(33)30-16-19-36-20-17-30)25(32)31(28)18-21-37(34,35)24-13-8-6-9-14-24/h6,8-9,13-14,23H,2-5,7,10-12,15-22,28H2,1H3,(H,29,33)