1-(3,4-dimethoxyphenyl)-3-(4-piperidin-1-ylcarbonylphenyl)thiourea

Systemtic Name: 1-(3,4-dimethoxyphenyl)-3-(4-piperidin-1-ylcarbonylphenyl)thiourea Openeye Name: 1-(3,4-dimethoxyphenyl)-3-[4-(piperidine-1-carbonyl)phenyl]thiourea CAS Name: 1-(3,4-dimethoxyphenyl)-3-[4-[oxo(1-piperidinyl)methyl]phenyl]thiourea IUPAC Name: 1-(3,4-dimethoxyphenyl)-3-[4-(piperidine-1-carbonyl)phenyl]thiourea Traditional Name: 1-(3,4-dimethoxyphenyl)-3-[4-(piperidine-1-carbonyl)phenyl]thiourea Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=S)NC2=CC=C(C=C2)C(=O)N3CCCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=S)NC2=CC=C(C=C2)C(=O)N3CCCCC3)OC

InChI

InChI=1S/C21H25N3O3S/c1-26-18-11-10-17(14-19(18)27-2)23-21(28)22-16-8-6-15(7-9-16)20(25)24-12-4-3-5-13-24/h6-11,14H,3-5,12-13H2,1-2H3,(H2,22,23,28)