N-(3-phenylpropyl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(3-phenylpropyl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Openeye Name: N-(3-phenylpropyl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide CAS Name: N-(3-phenylpropyl)-2-(1-pyrrolyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(3-phenylpropyl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Traditional Name: N-(3-phenylpropyl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Formula: C21H19N3OS MolecularWeight: 361.46006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNC(=O)C2=CC3=C(C=C2)N=C(S3)N4C=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCCNC(=O)C2=CC3=C(C=C2)N=C(S3)N4C=CC=C4

InChI

InChI=1S/C21H19N3OS/c25-20(22-12-6-9-16-7-2-1-3-8-16)17-10-11-18-19(15-17)26-21(23-18)24-13-4-5-14-24/h1-5,7-8,10-11,13-15H,6,9,12H2,(H,22,25)