N-[3-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]-3-oxidanylidene-propyl]thiophene-3-carboxamide

Systemtic Name: N-[3-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]-3-oxidanylidene-propyl]thiophene-3-carboxamide Openeye Name: N-[3-[4-(4-ethylbenzoyl)piperazin-1-yl]-3-oxo-propyl]thiophene-3-carboxamide CAS Name: N-[3-[4-[(4-ethylphenyl)-oxomethyl]-1-piperazinyl]-3-oxopropyl]-3-thiophenecarboxamide IUPAC Name: N-[3-[4-(4-ethylbenzoyl)piperazin-1-yl]-3-oxopropyl]thiophene-3-carboxamide Traditional Name: N-[3-[4-(4-ethylbenzoyl)piperazino]-3-keto-propyl]thiophene-3-carboxamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)CCNC(=O)C3=CSC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)CCNC(=O)C3=CSC=C3

InChI

InChI=1S/C21H25N3O3S/c1-2-16-3-5-17(6-4-16)21(27)24-12-10-23(11-13-24)19(25)7-9-22-20(26)18-8-14-28-15-18/h3-6,8,14-15H,2,7,9-13H2,1H3,(H,22,26)