7-(3,6-dimethylpyrazin-2-yl)-9-methoxy-4-(thiophen-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: 7-(3,6-dimethylpyrazin-2-yl)-9-methoxy-4-(thiophen-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 7-(3,6-dimethylpyrazin-2-yl)-9-methoxy-4-(2-thienylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 7-(3,6-dimethyl-2-pyrazinyl)-9-methoxy-4-(thiophen-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 7-(3,6-dimethylpyrazin-2-yl)-9-methoxy-4-(thiophen-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 7-(3,6-dimethylpyrazin-2-yl)-9-methoxy-4-(2-thenyl)-3,5-dihydro-2H-1,4-benzoxazepine Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=N1)C2=CC3=C(C(=C2)OC)OCCN(C3)CC4=CC=CS4)C

Isomeric SMILES

CC1=CN=C(C(=N1)C2=CC3=C(C(=C2)OC)OCCN(C3)CC4=CC=CS4)C

InChI

InChI=1S/C21H23N3O2S/c1-14-11-22-15(2)20(23-14)16-9-17-12-24(13-18-5-4-8-27-18)6-7-26-21(17)19(10-16)25-3/h4-5,8-11H,6-7,12-13H2,1-3H3