10-azanyl-5-(phenylmethyl)benzo[b][1,4]benzothiazepin-6-one

Systemtic Name: 10-azanyl-5-(phenylmethyl)benzo[b][1,4]benzothiazepin-6-one Openeye Name: 10-amino-5-benzyl-benzo[b][1,4]benzothiazepin-6-one CAS Name: 10-amino-5-(phenylmethyl)-6-benzo[b][1,4]benzothiazepinone IUPAC Name: 10-amino-5-benzylbenzo[b][1,4]benzothiazepin-6-one Traditional Name: 10-amino-5-benzyl-benzo[b][1,4]benzothiazepin-6-one Formula: C20H16N2OS MolecularWeight: 332.41884

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=CC=CC=C3SC4=C(C2=O)C=CC=C4N

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=CC=CC=C3SC4=C(C2=O)C=CC=C4N

InChI

InChI=1S/C20H16N2OS/c21-16-10-6-9-15-19(16)24-18-12-5-4-11-17(18)22(20(15)23)13-14-7-2-1-3-8-14/h1-12H,13,21H2