1-[2-[(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)amino]ethanoylamino]-3-phenyl-thiourea

Systemtic Name: 1-[2-[(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)amino]ethanoylamino]-3-phenyl-thiourea Openeye Name: 1-[[2-[(5,5-dimethyl-3-oxo-cyclohexen-1-yl)amino]acetyl]amino]-3-phenyl-thiourea CAS Name: 1-[[2-[(5,5-dimethyl-3-oxo-1-cyclohexenyl)amino]-1-oxoethyl]amino]-3-phenylthiourea IUPAC Name: 1-[[2-[(5,5-dimethyl-3-oxocyclohexen-1-yl)amino]acetyl]amino]-3-phenylthiourea Traditional Name: 1-[[2-[(3-keto-5,5-dimethyl-cyclohexen-1-yl)amino]acetyl]amino]-3-phenyl-thiourea Formula: C17H22N4O2S MolecularWeight: 346.44718

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=O)C1)NCC(=O)NNC(=S)NC2=CC=CC=C2)C

Isomeric SMILES

CC1(CC(=CC(=O)C1)NCC(=O)NNC(=S)NC2=CC=CC=C2)C

InChI

InChI=1S/C17H22N4O2S/c1-17(2)9-13(8-14(22)10-17)18-11-15(23)20-21-16(24)19-12-6-4-3-5-7-12/h3-8,18H,9-11H2,1-2H3,(H,20,23)(H2,19,21,24)