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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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