N-(1,3-benzothiazol-2-ylmethyl)-4-[(3-methylphenyl)methyl]piperazine-1-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-4-[(3-methylphenyl)methyl]piperazine-1-carboxamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-4-(m-tolylmethyl)piperazine-1-carboxamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-4-[(3-methylphenyl)methyl]-1-piperazinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-4-[(3-methylphenyl)methyl]piperazine-1-carboxamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-4-(3-methylbenzyl)piperazine-1-carboxamide Formula: C21H24N4OS MolecularWeight: 380.50646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)NCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)NCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H24N4OS/c1-16-5-4-6-17(13-16)15-24-9-11-25(12-10-24)21(26)22-14-20-23-18-7-2-3-8-19(18)27-20/h2-8,13H,9-12,14-15H2,1H3,(H,22,26)