1-(4-cyanophenyl)-3-[[4-[(cyclopropylmethylcarbamoylamino)methyl]cyclohexyl]methyl]urea

Systemtic Name: 1-(4-cyanophenyl)-3-[[4-[(cyclopropylmethylcarbamoylamino)methyl]cyclohexyl]methyl]urea Openeye Name: 1-(4-cyanophenyl)-3-[[4-[(cyclopropylmethylcarbamoylamino)methyl]cyclohexyl]methyl]urea CAS Name: 1-[[4-[[[(4-cyanoanilino)-oxomethyl]amino]methyl]cyclohexyl]methyl]-3-(cyclopropylmethyl)urea IUPAC Name: 1-(4-cyanophenyl)-3-[[4-[(cyclopropylmethylcarbamoylamino)methyl]cyclohexyl]methyl]urea Traditional Name: 1-(4-cyanophenyl)-3-[[4-[(cyclopropylmethylcarbamoylamino)methyl]cyclohexyl]methyl]urea Formula: C21H29N5O2 MolecularWeight: 383.48726

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CNC(=O)NCC2CCC(CC2)CNC(=O)NC3=CC=C(C=C3)C#N

Isomeric SMILES

C1CC1CNC(=O)NCC2CCC(CC2)CNC(=O)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H29N5O2/c22-11-15-7-9-19(10-8-15)26-21(28)25-14-18-5-3-17(4-6-18)13-24-20(27)23-12-16-1-2-16/h7-10,16-18H,1-6,12-14H2,(H2,23,24,27)(H2,25,26,28)