N-[4-methoxy-7-[(4-methylphenyl)methylamino]-1,3-benzothiazol-2-yl]benzamide

Systemtic Name: N-[4-methoxy-7-[(4-methylphenyl)methylamino]-1,3-benzothiazol-2-yl]benzamide Openeye Name: N-[4-methoxy-7-(p-tolylmethylamino)-1,3-benzothiazol-2-yl]benzamide CAS Name: N-[4-methoxy-7-[(4-methylphenyl)methylamino]-1,3-benzothiazol-2-yl]benzamide IUPAC Name: N-[4-methoxy-7-[(4-methylphenyl)methylamino]-1,3-benzothiazol-2-yl]benzamide Traditional Name: N-[4-methoxy-7-[(4-methylbenzyl)amino]-1,3-benzothiazol-2-yl]benzamide Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC2=C3C(=C(C=C2)OC)N=C(S3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CNC2=C3C(=C(C=C2)OC)N=C(S3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H21N3O2S/c1-15-8-10-16(11-9-15)14-24-18-12-13-19(28-2)20-21(18)29-23(25-20)26-22(27)17-6-4-3-5-7-17/h3-13,24H,14H2,1-2H3,(H,25,26,27)