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

Systemtic Name: 1-[[2-oxidanylidene-4-[4-(phenylmethyl)pyridin-1-ium-1-yl]-1,3-thiazol-5-ylidene]methylamino]-3-phenyl-thiourea Openeye Name: 1-[[4-(4-benzylpyridin-1-ium-1-yl)-2-oxo-thiazol-5-ylidene]methylamino]-3-phenyl-thiourea CAS Name: 1-[[2-oxo-4-[4-(phenylmethyl)-1-pyridin-1-iumyl]-5-thiazolylidene]methylamino]-3-phenylthiourea IUPAC Name: 1-[[4-(4-benzylpyridin-1-ium-1-yl)-2-oxo-1,3-thiazol-5-ylidene]methylamino]-3-phenylthiourea Traditional Name: 1-[[4-(4-benzylpyridin-1-ium-1-yl)-2-keto-3-thiazolin-5-ylidene]methylamino]-3-phenyl-thiourea Formula: C23H20N5OS2+ MolecularWeight: 446.5678

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC=[N+](C=C2)C3=NC(=O)SC3=CNNC(=S)NC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC=[N+](C=C2)C3=NC(=O)SC3=CNNC(=S)NC4=CC=CC=C4

InChI

InChI=1S/C23H19N5OS2/c29-23-26-21(28-13-11-18(12-14-28)15-17-7-3-1-4-8-17)20(31-23)16-24-27-22(30)25-19-9-5-2-6-10-19/h1-14,16H,15H2,(H2-,24,25,26,27,29,30)/p+1