N-[1-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[1-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]thiophene-2-carboxamide Openeye Name: N-[1-[4-(4-ethylbenzoyl)piperazine-1-carbonyl]-2-methyl-propyl]thiophene-2-carboxamide CAS Name: N-[1-[4-[(4-ethylphenyl)-oxomethyl]-1-piperazinyl]-3-methyl-1-oxobutan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[1-[4-(4-ethylbenzoyl)piperazin-1-yl]-3-methyl-1-oxobutan-2-yl]thiophene-2-carboxamide Traditional Name: N-[1-[4-(4-ethylbenzoyl)piperazine-1-carbonyl]-2-methyl-propyl]thiophene-2-carboxamide Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C(C(C)C)NC(=O)C3=CC=CS3

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C(C(C)C)NC(=O)C3=CC=CS3

InChI

InChI=1S/C23H29N3O3S/c1-4-17-7-9-18(10-8-17)22(28)25-11-13-26(14-12-25)23(29)20(16(2)3)24-21(27)19-6-5-15-30-19/h5-10,15-16,20H,4,11-14H2,1-3H3,(H,24,27)