2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-[1-(phenylmethyl)pyrrolidin-3-yl]ethanamide

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-[1-(phenylmethyl)pyrrolidin-3-yl]ethanamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetamide CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-[1-(phenylmethyl)-3-pyrrolidinyl]acetamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)acetamide Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1NC(=O)CSC2=CC3=C(C=C2)OCCO3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CC1NC(=O)CSC2=CC3=C(C=C2)OCCO3)CC4=CC=CC=C4

InChI

InChI=1S/C21H24N2O3S/c24-21(15-27-18-6-7-19-20(12-18)26-11-10-25-19)22-17-8-9-23(14-17)13-16-4-2-1-3-5-16/h1-7,12,17H,8-11,13-15H2,(H,22,24)