1-[(6-methyl-3-prop-1-en-2-yl-cyclohexa-1,5-dien-1-yl)amino]-3-phenyl-thiourea

Systemtic Name: 1-[(6-methyl-3-prop-1-en-2-yl-cyclohexa-1,5-dien-1-yl)amino]-3-phenyl-thiourea Openeye Name: 1-[(3-isopropenyl-6-methyl-cyclohexa-1,5-dien-1-yl)amino]-3-phenyl-thiourea CAS Name: 1-[[6-methyl-3-(1-methylethenyl)-1-cyclohexa-1,5-dienyl]amino]-3-phenylthiourea IUPAC Name: 1-[(6-methyl-3-prop-1-en-2-ylcyclohexa-1,5-dien-1-yl)amino]-3-phenylthiourea Traditional Name: 1-[(3-isopropenyl-6-methyl-cyclohexa-1,5-dien-1-yl)amino]-3-phenyl-thiourea Formula: C17H21N3S MolecularWeight: 299.43374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(C=C1NNC(=S)NC2=CC=CC=C2)C(=C)C

Isomeric SMILES

CC1=CCC(C=C1NNC(=S)NC2=CC=CC=C2)C(=C)C

InChI

InChI=1S/C17H21N3S/c1-12(2)14-10-9-13(3)16(11-14)19-20-17(21)18-15-7-5-4-6-8-15/h4-9,11,14,19H,1,10H2,2-3H3,(H2,18,20,21)