1-cyano-2-(4-methoxyphenyl)-3-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)guanidine

Systemtic Name: 1-cyano-2-(4-methoxyphenyl)-3-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)guanidine Openeye Name: 1-cyano-2-(4-methoxyphenyl)-3-(2-thioxo-3H-1,3-benzothiazol-6-yl)guanidine CAS Name: 1-cyano-2-(4-methoxyphenyl)-3-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)guanidine IUPAC Name: 1-cyano-2-(4-methoxyphenyl)-3-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)guanidine Traditional Name: 1-cyano-2-(4-methoxyphenyl)-3-(2-thioxo-3H-1,3-benzothiazol-6-yl)guanidine Formula: C16H13N5OS2 MolecularWeight: 355.43732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N=C(NC#N)NC2=CC3=C(C=C2)NC(=S)S3

Isomeric SMILES

COC1=CC=C(C=C1)N=C(NC#N)NC2=CC3=C(C=C2)NC(=S)S3

InChI

InChI=1S/C16H13N5OS2/c1-22-12-5-2-10(3-6-12)19-15(18-9-17)20-11-4-7-13-14(8-11)24-16(23)21-13/h2-8H,1H3,(H,21,23)(H2,18,19,20)