3-ethyl-7-hexyl-5-(2-methylphenyl)-3,4-dihydrothieno[2,3-e][1,4]diazepin-2-one

Systemtic Name: 3-ethyl-7-hexyl-5-(2-methylphenyl)-3,4-dihydrothieno[2,3-e][1,4]diazepin-2-one Openeye Name: 3-ethyl-7-hexyl-5-(o-tolyl)-3,4-dihydrothieno[2,3-e][1,4]diazepin-2-one CAS Name: 3-ethyl-7-hexyl-5-(2-methylphenyl)-3,4-dihydrothieno[2,3-e][1,4]diazepin-2-one IUPAC Name: 3-ethyl-7-hexyl-5-(2-methylphenyl)-3,4-dihydrothieno[2,3-e][1,4]diazepin-2-one Traditional Name: 3-ethyl-7-hexyl-5-(o-tolyl)-3,4-dihydrothieno[2,3-e][1,4]diazepin-2-one Formula: C22H28N2OS MolecularWeight: 368.53552

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC2=C(NC(C(=O)N=C2S1)CC)C3=CC=CC=C3C

Isomeric SMILES

CCCCCCC1=CC2=C(NC(C(=O)N=C2S1)CC)C3=CC=CC=C3C

InChI

InChI=1S/C22H28N2OS/c1-4-6-7-8-12-16-14-18-20(17-13-10-9-11-15(17)3)23-19(5-2)21(25)24-22(18)26-16/h9-11,13-14,19,23H,4-8,12H2,1-3H3