1-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]-3-(4-nitrophenyl)thiourea Openeye Name: 1-[4-[(3-methyl-1-piperidyl)sulfonyl]phenyl]-3-(4-nitrophenyl)thiourea CAS Name: 1-[4-[(3-methyl-1-piperidinyl)sulfonyl]phenyl]-3-(4-nitrophenyl)thiourea IUPAC Name: 1-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]-3-(4-nitrophenyl)thiourea Traditional Name: 1-[4-(3-methylpiperidino)sulfonylphenyl]-3-(4-nitrophenyl)thiourea Formula: C19H22N4O4S2 MolecularWeight: 434.53238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O4S2/c1-14-3-2-12-22(13-14)29(26,27)18-10-6-16(7-11-18)21-19(28)20-15-4-8-17(9-5-15)23(24)25/h4-11,14H,2-3,12-13H2,1H3,(H2,20,21,28)