4-(1,3-benzothiazol-2-yl)-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]butanamide Openeye Name: 4-(1,3-benzothiazol-2-yl)-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]butanamide CAS Name: 4-(1,3-benzothiazol-2-yl)-N-[2-(3-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]butanamide IUPAC Name: 4-(1,3-benzothiazol-2-yl)-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]butanamide Traditional Name: 4-(1,3-benzothiazol-2-yl)-N-[2-(3-methoxyphenyl)-2-pyrrolidino-ethyl]butyramide Formula: C24H29N3O2S MolecularWeight: 423.57096

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(CNC(=O)CCCC2=NC3=CC=CC=C3S2)N4CCCC4

Isomeric SMILES

COC1=CC=CC(=C1)C(CNC(=O)CCCC2=NC3=CC=CC=C3S2)N4CCCC4

InChI

InChI=1S/C24H29N3O2S/c1-29-19-9-6-8-18(16-19)21(27-14-4-5-15-27)17-25-23(28)12-7-13-24-26-20-10-2-3-11-22(20)30-24/h2-3,6,8-11,16,21H,4-5,7,12-15,17H2,1H3,(H,25,28)