[4-[(2S)-2-phenyl-2,3-dihydro-1,5-benzothiazepin-4-yl]phenyl] N-methylcarbamate

Systemtic Name: [4-[(2S)-2-phenyl-2,3-dihydro-1,5-benzothiazepin-4-yl]phenyl] N-methylcarbamate Openeye Name: [4-[(2S)-2-phenyl-2,3-dihydro-1,5-benzothiazepin-4-yl]phenyl] N-methylcarbamate CAS Name: N-methylcarbamic acid [4-[(2S)-2-phenyl-2,3-dihydro-1,5-benzothiazepin-4-yl]phenyl] ester IUPAC Name: [4-[(2S)-2-phenyl-2,3-dihydro-1,5-benzothiazepin-4-yl]phenyl] N-methylcarbamate Traditional Name: N-methylcarbamic acid [4-[(2S)-2-phenyl-2,3-dihydro-1,5-benzothiazepin-4-yl]phenyl] ester Formula: C23H20N2O2S MolecularWeight: 388.4821

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)OC1=CC=C(C=C1)C2=NC3=CC=CC=C3SC(C2)C4=CC=CC=C4

Isomeric SMILES

CNC(=O)OC1=CC=C(C=C1)C2=NC3=CC=CC=C3S[C@@H](C2)C4=CC=CC=C4

InChI

InChI=1S/C23H20N2O2S/c1-24-23(26)27-18-13-11-16(12-14-18)20-15-22(17-7-3-2-4-8-17)28-21-10-6-5-9-19(21)25-20/h2-14,22H,15H2,1H3,(H,24,26)/t22-/m0/s1