5-chloranyl-3-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-3-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-5-chloro-3-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)pyrazole-4-carboxamide CAS Name: 5-chloro-3-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-5-chloro-3-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)pyrazole-4-carboxamide Traditional Name: 1-benzyl-5-chloro-3-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)pyrazole-4-carboxamide Formula: C20H17ClN4OS MolecularWeight: 396.89318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(N(N=C3C)CC4=CC=CC=C4)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(N(N=C3C)CC4=CC=CC=C4)Cl

InChI

InChI=1S/C20H17ClN4OS/c1-12-8-9-15-16(10-12)27-20(22-15)23-19(26)17-13(2)24-25(18(17)21)11-14-6-4-3-5-7-14/h3-10H,11H2,1-2H3,(H,22,23,26)