N-[3-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-propyl]thiophene-3-carboxamide

Systemtic Name: N-[3-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-propyl]thiophene-3-carboxamide Openeye Name: N-[3-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-3-oxo-propyl]thiophene-3-carboxamide CAS Name: N-[3-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-3-oxopropyl]-3-thiophenecarboxamide IUPAC Name: N-[3-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-3-oxopropyl]thiophene-3-carboxamide Traditional Name: N-[3-[4-(3,4-dimethylphenyl)sulfonylpiperazino]-3-keto-propyl]thiophene-3-carboxamide Formula: C20H25N3O4S2 MolecularWeight: 435.5602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCNC(=O)C3=CSC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCNC(=O)C3=CSC=C3)C

InChI

InChI=1S/C20H25N3O4S2/c1-15-3-4-18(13-16(15)2)29(26,27)23-10-8-22(9-11-23)19(24)5-7-21-20(25)17-6-12-28-14-17/h3-4,6,12-14H,5,7-11H2,1-2H3,(H,21,25)