1-cyclohexyl-3-(3-methoxy-4-propoxy-phenyl)-4-(thiophen-2-ylmethyl)piperazine-2,5-dione

Systemtic Name: 1-cyclohexyl-3-(3-methoxy-4-propoxy-phenyl)-4-(thiophen-2-ylmethyl)piperazine-2,5-dione Openeye Name: 1-cyclohexyl-3-(3-methoxy-4-propoxy-phenyl)-4-(2-thienylmethyl)piperazine-2,5-dione CAS Name: 1-cyclohexyl-3-(3-methoxy-4-propoxyphenyl)-4-(thiophen-2-ylmethyl)piperazine-2,5-dione IUPAC Name: 1-cyclohexyl-3-(3-methoxy-4-propoxyphenyl)-4-(thiophen-2-ylmethyl)piperazine-2,5-dione Traditional Name: 1-cyclohexyl-3-(3-methoxy-4-propoxy-phenyl)-4-(2-thenyl)piperazine-2,5-quinone Formula: C25H32N2O4S MolecularWeight: 456.59758

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C2C(=O)N(CC(=O)N2CC3=CC=CS3)C4CCCCC4)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C2C(=O)N(CC(=O)N2CC3=CC=CS3)C4CCCCC4)OC

InChI

InChI=1S/C25H32N2O4S/c1-3-13-31-21-12-11-18(15-22(21)30-2)24-25(29)26(19-8-5-4-6-9-19)17-23(28)27(24)16-20-10-7-14-32-20/h7,10-12,14-15,19,24H,3-6,8-9,13,16-17H2,1-2H3