4-(4-phenylphenyl)-2-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)-1,3-thiazole

Systemtic Name: 4-(4-phenylphenyl)-2-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)-1,3-thiazole Openeye Name: 4-(4-phenylphenyl)-2-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)thiazole CAS Name: 4-(4-phenylphenyl)-2-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)thiazole IUPAC Name: 4-(4-phenylphenyl)-2-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)-1,3-thiazole Traditional Name: 4-(4-phenylphenyl)-2-(6,7,8,9-tetrahydro-5H-[1,2,4]triazol[4,3-a]azepin-3-ylmethyl)thiazole Formula: C23H22N4S MolecularWeight: 386.51258

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NN=C(N2CC1)CC3=NC(=CS3)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCC2=NN=C(N2CC1)CC3=NC(=CS3)C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C23H22N4S/c1-3-7-17(8-4-1)18-10-12-19(13-11-18)20-16-28-23(24-20)15-22-26-25-21-9-5-2-6-14-27(21)22/h1,3-4,7-8,10-13,16H,2,5-6,9,14-15H2