8-chloranyl-6-(4-methyl-1,4-diazepan-1-yl)pyrrolo[2,1-b][1,3]benzothiazepine

Systemtic Name: 8-chloranyl-6-(4-methyl-1,4-diazepan-1-yl)pyrrolo[2,1-b][1,3]benzothiazepine Openeye Name: 8-chloro-6-(4-methyl-1,4-diazepan-1-yl)pyrrolo[2,1-b][1,3]benzothiazepine CAS Name: 8-chloro-6-(4-methyl-1,4-diazepan-1-yl)pyrrolo[2,1-b][1,3]benzothiazepine IUPAC Name: 8-chloro-6-(4-methyl-1,4-diazepan-1-yl)pyrrolo[2,1-b][1,3]benzothiazepine Traditional Name: 8-chloro-6-(4-methyl-1,4-diazepan-1-yl)pyrrolo[2,1-b][1,3]benzothiazepine Formula: C18H20ClN3S MolecularWeight: 345.8895

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C2=CN3C=CC=C3SC4=C2C=C(C=C4)Cl

Isomeric SMILES

CN1CCCN(CC1)C2=CN3C=CC=C3SC4=C2C=C(C=C4)Cl

InChI

InChI=1S/C18H20ClN3S/c1-20-7-3-9-21(11-10-20)16-13-22-8-2-4-18(22)23-17-6-5-14(19)12-15(16)17/h2,4-6,8,12-13H,3,7,9-11H2,1H3