1-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]-3-(pyridin-4-ylmethyl)thiourea

Systemtic Name: 1-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]-3-(pyridin-4-ylmethyl)thiourea Openeye Name: 1-[4-[(2-methyl-1-piperidyl)sulfonyl]phenyl]-3-(4-pyridylmethyl)thiourea CAS Name: 1-[4-[(2-methyl-1-piperidinyl)sulfonyl]phenyl]-3-(pyridin-4-ylmethyl)thiourea IUPAC Name: 1-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]-3-(pyridin-4-ylmethyl)thiourea Traditional Name: 1-[4-(2-methylpiperidino)sulfonylphenyl]-3-(4-pyridylmethyl)thiourea Formula: C19H24N4O2S2 MolecularWeight: 404.54946

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=S)NCC3=CC=NC=C3

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=S)NCC3=CC=NC=C3

InChI

InChI=1S/C19H24N4O2S2/c1-15-4-2-3-13-23(15)27(24,25)18-7-5-17(6-8-18)22-19(26)21-14-16-9-11-20-12-10-16/h5-12,15H,2-4,13-14H2,1H3,(H2,21,22,26)