ethyl (NZ)-N-[2-cyclohexyl-3-cyclohexylimino-4-(phenylmethyl)-1,2,4-thiadiazolidin-5-ylidene]sulfamate

Systemtic Name: ethyl (NZ)-N-[2-cyclohexyl-3-cyclohexylimino-4-(phenylmethyl)-1,2,4-thiadiazolidin-5-ylidene]sulfamate Openeye Name: ethyl (NZ)-N-(4-benzyl-2-cyclohexyl-3-cyclohexylimino-1,2,4-thiadiazolidin-5-ylidene)sulfamate CAS Name: (NZ)-N-[2-cyclohexyl-3-cyclohexylimino-4-(phenylmethyl)-1,2,4-thiadiazolidin-5-ylidene]sulfamic acid ethyl ester IUPAC Name: ethyl (NZ)-N-(4-benzyl-2-cyclohexyl-3-cyclohexylimino-1,2,4-thiadiazolidin-5-ylidene)sulfamate Traditional Name: (NZ)-N-(4-benzyl-2-cyclohexyl-3-cyclohexylimino-1,2,4-thiadiazolidin-5-ylidene)sulfamic acid ethyl ester Formula: C23H34N4O3S2 MolecularWeight: 478.67106

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Descriptors Computed from Structure

Canonical SMILES:

CCOS(=O)(=O)N=C1N(C(=NC2CCCCC2)N(S1)C3CCCCC3)CC4=CC=CC=C4

Isomeric SMILES

CCOS(=O)(=O)/N=C\1/N(C(=NC2CCCCC2)N(S1)C3CCCCC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H34N4O3S2/c1-2-30-32(28,29)25-23-26(18-19-12-6-3-7-13-19)22(24-20-14-8-4-9-15-20)27(31-23)21-16-10-5-11-17-21/h3,6-7,12-13,20-21H,2,4-5,8-11,14-18H2,1H3/b24-22?,25-23-