N-[3-[4-(1,3-benzothiazol-2-yl)butanoylamino]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[3-[4-(1,3-benzothiazol-2-yl)butanoylamino]phenyl]thiophene-2-carboxamide Openeye Name: N-[3-[4-(1,3-benzothiazol-2-yl)butanoylamino]phenyl]thiophene-2-carboxamide CAS Name: N-[3-[[4-(1,3-benzothiazol-2-yl)-1-oxobutyl]amino]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[3-[4-(1,3-benzothiazol-2-yl)butanoylamino]phenyl]thiophene-2-carboxamide Traditional Name: N-[3-[4-(1,3-benzothiazol-2-yl)butanoylamino]phenyl]thiophene-2-carboxamide Formula: C22H19N3O2S2 MolecularWeight: 421.53516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CCCC(=O)NC3=CC=CC(=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CCCC(=O)NC3=CC=CC(=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C22H19N3O2S2/c26-20(11-4-12-21-25-17-8-1-2-9-18(17)29-21)23-15-6-3-7-16(14-15)24-22(27)19-10-5-13-28-19/h1-3,5-10,13-14H,4,11-12H2,(H,23,26)(H,24,27)