7-propan-2-yl-2-(4-propan-2-ylphenyl)-5-thiophen-2-yl-4H-1,3,4-benzotriazepine

Systemtic Name: 7-propan-2-yl-2-(4-propan-2-ylphenyl)-5-thiophen-2-yl-4H-1,3,4-benzotriazepine Openeye Name: 7-isopropyl-2-(4-isopropylphenyl)-5-(2-thienyl)-4H-1,3,4-benzotriazepine CAS Name: 7-propan-2-yl-2-(4-propan-2-ylphenyl)-5-thiophen-2-yl-4H-1,3,4-benzotriazepine IUPAC Name: 7-propan-2-yl-2-(4-propan-2-ylphenyl)-5-thiophen-2-yl-4H-1,3,4-benzotriazepine Traditional Name: 7-isopropyl-2-p-cumenyl-5-(2-thienyl)-4H-1,3,4-benzotriazepine Formula: C24H25N3S MolecularWeight: 387.5404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NNC(=C3C=C(C=CC3=N2)C(C)C)C4=CC=CS4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NNC(=C3C=C(C=CC3=N2)C(C)C)C4=CC=CS4

InChI

InChI=1S/C24H25N3S/c1-15(2)17-7-9-18(10-8-17)24-25-21-12-11-19(16(3)4)14-20(21)23(26-27-24)22-6-5-13-28-22/h5-16,26H,1-4H3