1-[(2-oxidanylidene-4-pyridin-1-ium-1-yl-1,3-thiazol-5-ylidene)methylamino]-3-phenyl-thiourea

Systemtic Name: 1-[(2-oxidanylidene-4-pyridin-1-ium-1-yl-1,3-thiazol-5-ylidene)methylamino]-3-phenyl-thiourea Openeye Name: 1-[(2-oxo-4-pyridin-1-ium-1-yl-thiazol-5-ylidene)methylamino]-3-phenyl-thiourea CAS Name: 1-[[2-oxo-4-(1-pyridin-1-iumyl)-5-thiazolylidene]methylamino]-3-phenylthiourea IUPAC Name: 1-[(2-oxo-4-pyridin-1-ium-1-yl-1,3-thiazol-5-ylidene)methylamino]-3-phenylthiourea Traditional Name: 1-[(2-keto-4-pyridin-1-ium-1-yl-3-thiazolin-5-ylidene)methylamino]-3-phenyl-thiourea Formula: C16H14N5OS2+ MolecularWeight: 356.44526

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NNC=C2C(=NC(=O)S2)[N+]3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NNC=C2C(=NC(=O)S2)[N+]3=CC=CC=C3

InChI

InChI=1S/C16H13N5OS2/c22-16-19-14(21-9-5-2-6-10-21)13(24-16)11-17-20-15(23)18-12-7-3-1-4-8-12/h1-11H,(H2-,17,18,19,20,22,23)/p+1