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

Systemtic Name: N-[4-[3-(1,3-benzothiazol-2-yl)propylcarbamoyl]phenyl]thiophene-2-carboxamide Openeye Name: N-[4-[3-(1,3-benzothiazol-2-yl)propylcarbamoyl]phenyl]thiophene-2-carboxamide CAS Name: N-[4-[[3-(1,3-benzothiazol-2-yl)propylamino]-oxomethyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[3-(1,3-benzothiazol-2-yl)propylcarbamoyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[4-[3-(1,3-benzothiazol-2-yl)propylcarbamoyl]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)CCCNC(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

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

InChI

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