ethyl 4-[[2-[(4-methoxyphenyl)methylamino]phenyl]carbamothioylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[2-[(4-methoxyphenyl)methylamino]phenyl]carbamothioylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[2-[(4-methoxyphenyl)methylamino]phenyl]carbamothioylamino]piperidine-1-carboxylate CAS Name: 4-[[[2-[(4-methoxyphenyl)methylamino]anilino]-sulfanylidenemethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(4-methoxyphenyl)methylamino]phenyl]carbamothioylamino]piperidine-1-carboxylate Traditional Name: 4-[[2-(p-anisylamino)phenyl]thiocarbamoylamino]piperidine-1-carboxylic acid ethyl ester Formula: C23H30N4O3S MolecularWeight: 442.5743

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=S)NC2=CC=CC=C2NCC3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=S)NC2=CC=CC=C2NCC3=CC=C(C=C3)OC

InChI

InChI=1S/C23H30N4O3S/c1-3-30-23(28)27-14-12-18(13-15-27)25-22(31)26-21-7-5-4-6-20(21)24-16-17-8-10-19(29-2)11-9-17/h4-11,18,24H,3,12-16H2,1-2H3,(H2,25,26,31)