2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(E)-(3-methoxy-4-propan-2-yloxy-phenyl)methylideneamino]ethanamide

Systemtic Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(E)-(3-methoxy-4-propan-2-yloxy-phenyl)methylideneamino]ethanamide Openeye Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(E)-(4-isopropoxy-3-methoxy-phenyl)methyleneamino]acetamide CAS Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-N-[(E)-(3-methoxy-4-propan-2-yloxyphenyl)methylideneamino]acetamide IUPAC Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(E)-(3-methoxy-4-propan-2-yloxyphenyl)methylideneamino]acetamide Traditional Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-N-[(E)-(4-isopropoxy-3-methoxy-benzylidene)amino]acetamide Formula: C27H27N5O3S MolecularWeight: 501.59998

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C=NNC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)/C=N/NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4)OC

InChI

InChI=1S/C27H27N5O3S/c1-19(2)35-23-15-14-20(16-24(23)34-3)17-28-29-25(33)18-36-27-31-30-26(21-10-6-4-7-11-21)32(27)22-12-8-5-9-13-22/h4-17,19H,18H2,1-3H3,(H,29,33)/b28-17+