N-(4-chlorophenyl)-1-ethyl-N-[(4S)-4-methyl-4,5-dihydro-1,3-thiazol-2-yl]benzotriazole-5-carboxamide

Systemtic Name: N-(4-chlorophenyl)-1-ethyl-N-[(4S)-4-methyl-4,5-dihydro-1,3-thiazol-2-yl]benzotriazole-5-carboxamide Openeye Name: N-(4-chlorophenyl)-1-ethyl-N-[(4S)-4-methyl-4,5-dihydrothiazol-2-yl]benzotriazole-5-carboxamide CAS Name: N-(4-chlorophenyl)-1-ethyl-N-[(4S)-4-methyl-4,5-dihydrothiazol-2-yl]-5-benzotriazolecarboxamide IUPAC Name: N-(4-chlorophenyl)-1-ethyl-N-[(4S)-4-methyl-4,5-dihydro-1,3-thiazol-2-yl]benzotriazole-5-carboxamide Traditional Name: N-(4-chlorophenyl)-1-ethyl-N-[(4S)-4-methyl-2-thiazolin-2-yl]benzotriazole-5-carboxamide Formula: C19H18ClN5OS MolecularWeight: 399.89712

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)N(C3=CC=C(C=C3)Cl)C4=NC(CS4)C)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)N(C3=CC=C(C=C3)Cl)C4=N[C@H](CS4)C)N=N1

InChI

InChI=1S/C19H18ClN5OS/c1-3-24-17-9-4-13(10-16(17)22-23-24)18(26)25(19-21-12(2)11-27-19)15-7-5-14(20)6-8-15/h4-10,12H,3,11H2,1-2H3/t12-/m0/s1