N-[3-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]carbonylphenyl]thiophene-2-carboxamide

Systemtic Name: N-[3-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]carbonylphenyl]thiophene-2-carboxamide Openeye Name: N-[3-[4-(4-ethylbenzoyl)piperazine-1-carbonyl]phenyl]thiophene-2-carboxamide CAS Name: N-[3-[[4-[(4-ethylphenyl)-oxomethyl]-1-piperazinyl]-oxomethyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[3-[4-(4-ethylbenzoyl)piperazine-1-carbonyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[3-[4-(4-ethylbenzoyl)piperazine-1-carbonyl]phenyl]thiophene-2-carboxamide Formula: C25H25N3O3S MolecularWeight: 447.5493

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C25H25N3O3S/c1-2-18-8-10-19(11-9-18)24(30)27-12-14-28(15-13-27)25(31)20-5-3-6-21(17-20)26-23(29)22-7-4-16-32-22/h3-11,16-17H,2,12-15H2,1H3,(H,26,29)