(5S)-2-[(4-methoxyphenyl)carbonylamino]-7-oxidanylidene-N-(2-thiophen-2-ylethyl)-5,6-dihydro-4H-1,3-benzothiazole-5-carboxamide

Systemtic Name: (5S)-2-[(4-methoxyphenyl)carbonylamino]-7-oxidanylidene-N-(2-thiophen-2-ylethyl)-5,6-dihydro-4H-1,3-benzothiazole-5-carboxamide Openeye Name: (5S)-2-[(4-methoxybenzoyl)amino]-7-oxo-N-[2-(2-thienyl)ethyl]-5,6-dihydro-4H-1,3-benzothiazole-5-carboxamide CAS Name: (5S)-2-[[(4-methoxyphenyl)-oxomethyl]amino]-7-oxo-N-(2-thiophen-2-ylethyl)-5,6-dihydro-4H-1,3-benzothiazole-5-carboxamide IUPAC Name: (5S)-2-[(4-methoxybenzoyl)amino]-7-oxo-N-(2-thiophen-2-ylethyl)-5,6-dihydro-4H-1,3-benzothiazole-5-carboxamide Traditional Name: (5S)-7-keto-2-(p-anisoylamino)-N-[2-(2-thienyl)ethyl]-5,6-dihydro-4H-1,3-benzothiazole-5-carboxamide Formula: C22H21N3O4S2 MolecularWeight: 455.54984

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC2=NC3=C(S2)C(=O)CC(C3)C(=O)NCCC4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC2=NC3=C(S2)C(=O)C[C@H](C3)C(=O)NCCC4=CC=CS4

InChI

InChI=1S/C22H21N3O4S2/c1-29-15-6-4-13(5-7-15)21(28)25-22-24-17-11-14(12-18(26)19(17)31-22)20(27)23-9-8-16-3-2-10-30-16/h2-7,10,14H,8-9,11-12H2,1H3,(H,23,27)(H,24,25,28)/t14-/m0/s1