4-[[(6R)-3-aminocarbonyl-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-4-oxidanylidene-but-2-enoate

Systemtic Name: 4-[[(6R)-3-aminocarbonyl-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-4-oxidanylidene-but-2-enoate Openeye Name: 4-[[(6R)-3-carbamoyl-6-propyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]amino]-4-oxo-but-2-enoate CAS Name: 4-[[(6R)-3-carbamoyl-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-4-oxo-2-butenoate IUPAC Name: 4-[[(6R)-3-carbamoyl-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-4-oxobut-2-enoate Traditional Name: 4-[[(6R)-3-carbamoyl-6-propyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]amino]-4-keto-but-2-enoate Formula: C16H19N2O4S- MolecularWeight: 335.39806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C=CC(=O)[O-]

Isomeric SMILES

CCC[C@@H]1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C=CC(=O)[O-]

InChI

InChI=1S/C16H20N2O4S/c1-2-3-9-4-5-10-11(8-9)23-16(14(10)15(17)22)18-12(19)6-7-13(20)21/h6-7,9H,2-5,8H2,1H3,(H2,17,22)(H,18,19)(H,20,21)/p-1/t9-/m1/s1