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5-[1-[2-[(3,4-dimethoxyphenyl)methylamino]ethyl]pyrazol-3-yl]-N-oxidanyl-thiophene-2-carboxamide
5-[1-[2-[(3,4-dimethoxyphenyl)methylamino]ethyl]pyrazol-3-yl]-N-oxidanyl-thiophene-2-carboxamide
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Descriptors Computed from Structure
Canonical SMILES:
COC1=C(C=C(C=C1)CNCCN2C=CC(=N2)C3=CC=C(S3)C(=O)NO)OC
Isomeric SMILES
COC1=C(C=C(C=C1)CNCCN2C=CC(=N2)C3=CC=C(S3)C(=O)NO)OC
InChI
InChI=1S/C19H22N4O4S/c1-26-15-4-3-13(11-16(15)27-2)12-20-8-10-23-9-7-14(21-23)17-5-6-18(28-17)19(24)22-25/h3-7,9,11,20,25H,8,10,12H2,1-2H3,(H,22,24)
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