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

Systemtic Name: 5-(2,4-dimethylphenyl)-7-hexyl-3,4-dihydrothieno[2,3-e][1,4]diazepin-2-one Openeye Name: 5-(2,4-dimethylphenyl)-7-hexyl-3,4-dihydrothieno[2,3-e][1,4]diazepin-2-one CAS Name: 5-(2,4-dimethylphenyl)-7-hexyl-3,4-dihydrothieno[2,3-e][1,4]diazepin-2-one IUPAC Name: 5-(2,4-dimethylphenyl)-7-hexyl-3,4-dihydrothieno[2,3-e][1,4]diazepin-2-one Traditional Name: 5-(2,4-dimethylphenyl)-7-hexyl-3,4-dihydrothieno[2,3-e][1,4]diazepin-2-one Formula: C21H26N2OS MolecularWeight: 354.50894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC2=C(NCC(=O)N=C2S1)C3=C(C=C(C=C3)C)C

Isomeric SMILES

CCCCCCC1=CC2=C(NCC(=O)N=C2S1)C3=C(C=C(C=C3)C)C

InChI

InChI=1S/C21H26N2OS/c1-4-5-6-7-8-16-12-18-20(17-10-9-14(2)11-15(17)3)22-13-19(24)23-21(18)25-16/h9-12,22H,4-8,13H2,1-3H3