1-[6-(4-cyclopropylcarbonyl-1,4-diazepan-1-yl)pyridin-3-yl]-3-(3,4-dimethylphenyl)urea

Systemtic Name: 1-[6-(4-cyclopropylcarbonyl-1,4-diazepan-1-yl)pyridin-3-yl]-3-(3,4-dimethylphenyl)urea Openeye Name: 1-[6-[4-(cyclopropanecarbonyl)-1,4-diazepan-1-yl]-3-pyridyl]-3-(3,4-dimethylphenyl)urea CAS Name: 1-[6-[4-[cyclopropyl(oxo)methyl]-1,4-diazepan-1-yl]-3-pyridinyl]-3-(3,4-dimethylphenyl)urea IUPAC Name: 1-[6-[4-(cyclopropanecarbonyl)-1,4-diazepan-1-yl]pyridin-3-yl]-3-(3,4-dimethylphenyl)urea Traditional Name: 1-[6-[4-(cyclopropanecarbonyl)-1,4-diazepan-1-yl]-3-pyridyl]-3-(3,4-dimethylphenyl)urea Formula: C23H29N5O2 MolecularWeight: 407.50866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NC2=CN=C(C=C2)N3CCCN(CC3)C(=O)C4CC4)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NC2=CN=C(C=C2)N3CCCN(CC3)C(=O)C4CC4)C

InChI

InChI=1S/C23H29N5O2/c1-16-4-7-19(14-17(16)2)25-23(30)26-20-8-9-21(24-15-20)27-10-3-11-28(13-12-27)22(29)18-5-6-18/h4,7-9,14-15,18H,3,5-6,10-13H2,1-2H3,(H2,25,26,30)