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

Systemtic Name: 1-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methylamino]-3-pyridin-3-yl-thiourea Openeye Name: 1-[(4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-3-(3-pyridyl)thiourea CAS Name: 1-[(4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-3-(3-pyridinyl)thiourea IUPAC Name: 1-[(4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-3-pyridin-3-ylthiourea Traditional Name: 1-[(4-ketocyclohexa-2,5-dien-1-ylidene)methylamino]-3-(3-pyridyl)thiourea Formula: C13H12N4OS MolecularWeight: 272.32558

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12N4OS/c18-12-5-3-10(4-6-12)8-15-17-13(19)16-11-2-1-7-14-9-11/h1-9,15H,(H2,16,17,19)