N'-methyl-5-phenylsulfanyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)pyrrole-3-carbohydrazide

Systemtic Name: N'-methyl-5-phenylsulfanyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)pyrrole-3-carbohydrazide Openeye Name: 4-isopropyl-N'-methyl-5-phenylsulfanyl-1-(4-pyridylmethyl)pyrrole-3-carbohydrazide CAS Name: N'-methyl-5-(phenylthio)-4-propan-2-yl-1-(pyridin-4-ylmethyl)-3-pyrrolecarbohydrazide IUPAC Name: N'-methyl-5-phenylsulfanyl-4-propan-2-yl-1-(pyridin-4-ylmethyl)pyrrole-3-carbohydrazide Traditional Name: 4-isopropyl-N'-methyl-5-(phenylthio)-1-(4-pyridylmethyl)pyrrole-3-carbohydrazide Formula: C21H24N4OS MolecularWeight: 380.50646

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N(C=C1C(=O)NNC)CC2=CC=NC=C2)SC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=C(N(C=C1C(=O)NNC)CC2=CC=NC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C21H24N4OS/c1-15(2)19-18(20(26)24-22-3)14-25(13-16-9-11-23-12-10-16)21(19)27-17-7-5-4-6-8-17/h4-12,14-15,22H,13H2,1-3H3,(H,24,26)