N-(2,3-dihydro-1H-inden-2-yl)-4-(4-nitrophenyl)piperazine-1-carbothioamide

Systemtic Name: N-(2,3-dihydro-1H-inden-2-yl)-4-(4-nitrophenyl)piperazine-1-carbothioamide Openeye Name: N-indan-2-yl-4-(4-nitrophenyl)piperazine-1-carbothioamide CAS Name: N-(2,3-dihydro-1H-inden-2-yl)-4-(4-nitrophenyl)-1-piperazinecarbothioamide IUPAC Name: N-(2,3-dihydro-1H-inden-2-yl)-4-(4-nitrophenyl)piperazine-1-carbothioamide Traditional Name: N-indan-2-yl-4-(4-nitrophenyl)piperazine-1-carbothioamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=S)NC3CC4=CC=CC=C4C3

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=S)NC3CC4=CC=CC=C4C3

InChI

InChI=1S/C20H22N4O2S/c25-24(26)19-7-5-18(6-8-19)22-9-11-23(12-10-22)20(27)21-17-13-15-3-1-2-4-16(15)14-17/h1-8,17H,9-14H2,(H,21,27)