3-(3-chloranyl-2-methyl-phenyl)-1-(furan-2-ylmethyl)-1-(1-propan-2-ylpiperidin-4-yl)thiourea

Systemtic Name: 3-(3-chloranyl-2-methyl-phenyl)-1-(furan-2-ylmethyl)-1-(1-propan-2-ylpiperidin-4-yl)thiourea Openeye Name: 3-(3-chloro-2-methyl-phenyl)-1-(2-furylmethyl)-1-(1-isopropyl-4-piperidyl)thiourea CAS Name: 3-(3-chloro-2-methylphenyl)-1-(2-furanylmethyl)-1-(1-propan-2-yl-4-piperidinyl)thiourea IUPAC Name: 3-(3-chloro-2-methylphenyl)-1-(furan-2-ylmethyl)-1-(1-propan-2-ylpiperidin-4-yl)thiourea Traditional Name: 3-(3-chloro-2-methyl-phenyl)-1-(2-furfuryl)-1-(1-isopropyl-4-piperidyl)thiourea Formula: C21H28ClN3OS MolecularWeight: 405.98452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)N(CC2=CC=CO2)C3CCN(CC3)C(C)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)N(CC2=CC=CO2)C3CCN(CC3)C(C)C

InChI

InChI=1S/C21H28ClN3OS/c1-15(2)24-11-9-17(10-12-24)25(14-18-6-5-13-26-18)21(27)23-20-8-4-7-19(22)16(20)3/h4-8,13,15,17H,9-12,14H2,1-3H3,(H,23,27)