1-[(3-chloranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[(3-chloranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[(3-chloro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]thiourea CAS Name: 1-[(3-chloro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[(3-chloro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]thiourea Traditional Name: 1-benzyl-3-[(3-chloro-6-keto-cyclohexa-2,4-dien-1-ylidene)methylamino]thiourea Formula: C15H14ClN3OS MolecularWeight: 319.80916

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)NNC=C2C=C(C=CC2=O)Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)NNC=C2C=C(C=CC2=O)Cl

InChI

InChI=1S/C15H14ClN3OS/c16-13-6-7-14(20)12(8-13)10-18-19-15(21)17-9-11-4-2-1-3-5-11/h1-8,10,18H,9H2,(H2,17,19,21)