7-(1,3-benzothiazol-2-yl)-9-methoxy-4-(2-methylpropyl)-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: 7-(1,3-benzothiazol-2-yl)-9-methoxy-4-(2-methylpropyl)-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 7-(1,3-benzothiazol-2-yl)-4-isobutyl-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 7-(1,3-benzothiazol-2-yl)-9-methoxy-4-(2-methylpropyl)-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 7-(1,3-benzothiazol-2-yl)-9-methoxy-4-(2-methylpropyl)-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 7-(1,3-benzothiazol-2-yl)-4-isobutyl-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepine Formula: C21H24N2O2S MolecularWeight: 368.49246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CCOC2=C(C1)C=C(C=C2OC)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(C)CN1CCOC2=C(C1)C=C(C=C2OC)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H24N2O2S/c1-14(2)12-23-8-9-25-20-16(13-23)10-15(11-18(20)24-3)21-22-17-6-4-5-7-19(17)26-21/h4-7,10-11,14H,8-9,12-13H2,1-3H3