N-[(2S)-1-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]furan-2-carboxamide

Systemtic Name: N-[(2S)-1-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]furan-2-carboxamide Openeye Name: N-[(1S)-1-[4-(benzothiophen-3-ylmethyl)piperazine-1-carbonyl]-2-methyl-propyl]furan-2-carboxamide CAS Name: N-[(2S)-1-[4-(1-benzothiophen-3-ylmethyl)-1-piperazinyl]-3-methyl-1-oxobutan-2-yl]-2-furancarboxamide IUPAC Name: N-[(2S)-1-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-3-methyl-1-oxobutan-2-yl]furan-2-carboxamide Traditional Name: N-[(1S)-1-[4-(benzothiophen-3-ylmethyl)piperazine-1-carbonyl]-2-methyl-propyl]-2-furamide Formula: C23H27N3O3S MolecularWeight: 425.54378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCN(CC1)CC2=CSC3=CC=CC=C32)NC(=O)C4=CC=CO4

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCN(CC1)CC2=CSC3=CC=CC=C32)NC(=O)C4=CC=CO4

InChI

InChI=1S/C23H27N3O3S/c1-16(2)21(24-22(27)19-7-5-13-29-19)23(28)26-11-9-25(10-12-26)14-17-15-30-20-8-4-3-6-18(17)20/h3-8,13,15-16,21H,9-12,14H2,1-2H3,(H,24,27)/t21-/m0/s1