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

Systemtic Name: 1-methyl-1-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methylamino]-3-(phenylmethyl)thiourea Openeye Name: 3-benzyl-1-methyl-1-[(4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]thiourea CAS Name: 1-methyl-1-[(4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-3-(phenylmethyl)thiourea IUPAC Name: 3-benzyl-1-methyl-1-[(4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]thiourea Traditional Name: 3-benzyl-1-[(4-ketocyclohexa-2,5-dien-1-ylidene)methylamino]-1-methyl-thiourea Formula: C16H17N3OS MolecularWeight: 299.39068

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=S)NCC1=CC=CC=C1)NC=C2C=CC(=O)C=C2

Isomeric SMILES

CN(C(=S)NCC1=CC=CC=C1)NC=C2C=CC(=O)C=C2

InChI

InChI=1S/C16H17N3OS/c1-19(18-12-14-7-9-15(20)10-8-14)16(21)17-11-13-5-3-2-4-6-13/h2-10,12,18H,11H2,1H3,(H,17,21)