1-(2-methoxy-5-methyl-phenyl)-3-[(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methylamino]thiourea

Systemtic Name: 1-(2-methoxy-5-methyl-phenyl)-3-[(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methylamino]thiourea Openeye Name: 1-(2-methoxy-5-methyl-phenyl)-3-[(6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]thiourea CAS Name: 1-(2-methoxy-5-methylphenyl)-3-[(6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]thiourea IUPAC Name: 1-(2-methoxy-5-methylphenyl)-3-[(6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]thiourea Traditional Name: 1-[(6-ketocyclohexa-2,4-dien-1-ylidene)methylamino]-3-(2-methoxy-5-methyl-phenyl)thiourea Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=S)NNC=C2C=CC=CC2=O

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=S)NNC=C2C=CC=CC2=O

InChI

InChI=1S/C16H17N3O2S/c1-11-7-8-15(21-2)13(9-11)18-16(22)19-17-10-12-5-3-4-6-14(12)20/h3-10,17H,1-2H3,(H2,18,19,22)