N-[4-[(5-ethyl-6-oxidanylidene-benzo[b][1,4]benzothiazepin-3-yl)carbamoylamino]phenyl]ethanamide

Systemtic Name: N-[4-[(5-ethyl-6-oxidanylidene-benzo[b][1,4]benzothiazepin-3-yl)carbamoylamino]phenyl]ethanamide Openeye Name: N-[4-[(5-ethyl-6-oxo-benzo[b][1,4]benzothiazepin-3-yl)carbamoylamino]phenyl]acetamide CAS Name: N-[4-[[[(5-ethyl-6-oxo-3-benzo[b][1,4]benzothiazepinyl)amino]-oxomethyl]amino]phenyl]acetamide IUPAC Name: N-[4-[(5-ethyl-6-oxobenzo[b][1,4]benzothiazepin-3-yl)carbamoylamino]phenyl]acetamide Traditional Name: N-[4-[(5-ethyl-6-keto-benzo[b][1,4]benzothiazepin-3-yl)carbamoylamino]phenyl]acetamide Formula: C24H22N4O3S MolecularWeight: 446.52148

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2)NC(=O)NC3=CC=C(C=C3)NC(=O)C)SC4=CC=CC=C4C1=O

Isomeric SMILES

CCN1C2=C(C=CC(=C2)NC(=O)NC3=CC=C(C=C3)NC(=O)C)SC4=CC=CC=C4C1=O

InChI

InChI=1S/C24H22N4O3S/c1-3-28-20-14-18(12-13-22(20)32-21-7-5-4-6-19(21)23(28)30)27-24(31)26-17-10-8-16(9-11-17)25-15(2)29/h4-14H,3H2,1-2H3,(H,25,29)(H2,26,27,31)