N-(6-methoxy-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-4-thiophen-2-yl-butanamide

Systemtic Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-4-thiophen-2-yl-butanamide Openeye Name: N-benzyl-N-(6-methoxy-1,3-benzothiazol-2-yl)-4-(2-thienyl)butanamide CAS Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-4-thiophen-2-ylbutanamide IUPAC Name: N-benzyl-N-(6-methoxy-1,3-benzothiazol-2-yl)-4-thiophen-2-ylbutanamide Traditional Name: N-benzyl-N-(6-methoxy-1,3-benzothiazol-2-yl)-4-(2-thienyl)butyramide Formula: C23H22N2O2S2 MolecularWeight: 422.56298

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CC=C3)C(=O)CCCC4=CC=CS4

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CC=C3)C(=O)CCCC4=CC=CS4

InChI

InChI=1S/C23H22N2O2S2/c1-27-18-12-13-20-21(15-18)29-23(24-20)25(16-17-7-3-2-4-8-17)22(26)11-5-9-19-10-6-14-28-19/h2-4,6-8,10,12-15H,5,9,11,16H2,1H3