1-[(Z)-(3,3-dimethyl-5-oxidanylidene-cyclohexylidene)amino]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[(Z)-(3,3-dimethyl-5-oxidanylidene-cyclohexylidene)amino]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[(Z)-(3,3-dimethyl-5-oxo-cyclohexylidene)amino]thiourea CAS Name: 1-[(Z)-(3,3-dimethyl-5-oxocyclohexylidene)amino]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[(Z)-(3,3-dimethyl-5-oxocyclohexylidene)amino]thiourea Traditional Name: 1-benzyl-3-[(Z)-(5-keto-3,3-dimethyl-cyclohexylidene)amino]thiourea Formula: C16H21N3OS MolecularWeight: 303.42244

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=NNC(=S)NCC2=CC=CC=C2)CC(=O)C1)C

Isomeric SMILES

CC1(C/C(=N/NC(=S)NCC2=CC=CC=C2)/CC(=O)C1)C

InChI

InChI=1S/C16H21N3OS/c1-16(2)9-13(8-14(20)10-16)18-19-15(21)17-11-12-6-4-3-5-7-12/h3-7H,8-11H2,1-2H3,(H2,17,19,21)/b18-13+