2-[(3-chlorophenyl)amino]-N-(6-methyl-1,3-benzothiazol-2-yl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[(3-chlorophenyl)amino]-N-(6-methyl-1,3-benzothiazol-2-yl)-1,3-thiazole-4-carboxamide Openeye Name: 2-(3-chloroanilino)-N-(6-methyl-1,3-benzothiazol-2-yl)thiazole-4-carboxamide CAS Name: 2-(3-chloroanilino)-N-(6-methyl-1,3-benzothiazol-2-yl)-4-thiazolecarboxamide IUPAC Name: 2-(3-chloroanilino)-N-(6-methyl-1,3-benzothiazol-2-yl)-1,3-thiazole-4-carboxamide Traditional Name: 2-(3-chloroanilino)-N-(6-methyl-1,3-benzothiazol-2-yl)thiazole-4-carboxamide Formula: C18H13ClN4OS2 MolecularWeight: 400.90502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CSC(=N3)NC4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CSC(=N3)NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C18H13ClN4OS2/c1-10-5-6-13-15(7-10)26-18(21-13)23-16(24)14-9-25-17(22-14)20-12-4-2-3-11(19)8-12/h2-9H,1H3,(H,20,22)(H,21,23,24)