1-(1,3-benzodioxol-5-yl)-4-[4-(thiophen-3-ylmethyl)piperazin-1-yl]carbonyl-pyrrolidin-2-one

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-4-[4-(thiophen-3-ylmethyl)piperazin-1-yl]carbonyl-pyrrolidin-2-one Openeye Name: 1-(1,3-benzodioxol-5-yl)-4-[4-(3-thienylmethyl)piperazine-1-carbonyl]pyrrolidin-2-one CAS Name: 1-(1,3-benzodioxol-5-yl)-4-[oxo-[4-(3-thiophenylmethyl)-1-piperazinyl]methyl]-2-pyrrolidinone IUPAC Name: 1-(1,3-benzodioxol-5-yl)-4-[4-(thiophen-3-ylmethyl)piperazine-1-carbonyl]pyrrolidin-2-one Traditional Name: 1-(1,3-benzodioxol-5-yl)-4-[4-(3-thenyl)piperazine-1-carbonyl]-2-pyrrolidone Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CSC=C2)C(=O)C3CC(=O)N(C3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CCN1CC2=CSC=C2)C(=O)C3CC(=O)N(C3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H23N3O4S/c25-20-9-16(12-24(20)17-1-2-18-19(10-17)28-14-27-18)21(26)23-6-4-22(5-7-23)11-15-3-8-29-13-15/h1-3,8,10,13,16H,4-7,9,11-12,14H2