(10,13-dimethyl-17-oxidanylidene-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl) carbamimidothioate

Systemtic Name: (10,13-dimethyl-17-oxidanylidene-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl) carbamimidothioate Openeye Name: 2-(10,13-dimethyl-17-oxo-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl)isothiourea CAS Name: carbamimidothioic acid (10,13-dimethyl-17-oxo-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl) ester IUPAC Name: (10,13-dimethyl-17-oxo-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl) carbamimidothioate Traditional Name: 2-(17-keto-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl)isothiourea Formula: C20H30N2OS MolecularWeight: 346.53

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC3C(C1CCC2=O)CC=C4C3(CCC(C4)SC(=N)N)C

Isomeric SMILES

CC12CCC3C(C1CCC2=O)CC=C4C3(CCC(C4)SC(=N)N)C

InChI

InChI=1S/C20H30N2OS/c1-19-9-7-13(24-18(21)22)11-12(19)3-4-14-15-5-6-17(23)20(15,2)10-8-16(14)19/h3,13-16H,4-11H2,1-2H3,(H3,21,22)