2-(3-phenylpropanoylamino)-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxamide

Systemtic Name: 2-(3-phenylpropanoylamino)-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxamide Openeye Name: 2-(3-phenylpropanoylamino)-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxamide CAS Name: 2-[(1-oxo-3-phenylpropyl)amino]-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxamide IUPAC Name: 2-(3-phenylpropanoylamino)-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxamide Traditional Name: 2-(hydrocinnamoylamino)-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxamide Formula: C17H19N3O2S MolecularWeight: 329.41666

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C1)SC(=N2)NC(=O)CCC3=CC=CC=C3)C(=O)N

Isomeric SMILES

C1CC(C2=C(C1)SC(=N2)NC(=O)CCC3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C17H19N3O2S/c18-16(22)12-7-4-8-13-15(12)20-17(23-13)19-14(21)10-9-11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10H2,(H2,18,22)(H,19,20,21)