2-[4-oxidanylidene-3-(phenylcarbamoylamino)-2,3-dihydro-1,5-benzothiazepin-5-yl]-N-phenyl-N-propan-2-yl-ethanamide

Systemtic Name: 2-[4-oxidanylidene-3-(phenylcarbamoylamino)-2,3-dihydro-1,5-benzothiazepin-5-yl]-N-phenyl-N-propan-2-yl-ethanamide Openeye Name: N-isopropyl-2-[4-oxo-3-(phenylcarbamoylamino)-2,3-dihydro-1,5-benzothiazepin-5-yl]-N-phenyl-acetamide CAS Name: 2-[3-[[anilino(oxo)methyl]amino]-4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl]-N-phenyl-N-propan-2-ylacetamide IUPAC Name: 2-[4-oxo-3-(phenylcarbamoylamino)-2,3-dihydro-1,5-benzothiazepin-5-yl]-N-phenyl-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-[4-keto-3-(phenylcarbamoylamino)-2,3-dihydro-1,5-benzothiazepin-5-yl]-N-phenyl-acetamide Formula: C27H28N4O3S MolecularWeight: 488.60122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC=CC=C1)C(=O)CN2C3=CC=CC=C3SCC(C2=O)NC(=O)NC4=CC=CC=C4

Isomeric SMILES

CC(C)N(C1=CC=CC=C1)C(=O)CN2C3=CC=CC=C3SCC(C2=O)NC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C27H28N4O3S/c1-19(2)31(21-13-7-4-8-14-21)25(32)17-30-23-15-9-10-16-24(23)35-18-22(26(30)33)29-27(34)28-20-11-5-3-6-12-20/h3-16,19,22H,17-18H2,1-2H3,(H2,28,29,34)