N-[3-(cyclohexylcarbonylamino)-4-methyl-phenyl]isoquinoline-1-carboxamide

Systemtic Name: N-[3-(cyclohexylcarbonylamino)-4-methyl-phenyl]isoquinoline-1-carboxamide Openeye Name: N-[3-(cyclohexanecarbonylamino)-4-methyl-phenyl]isoquinoline-1-carboxamide CAS Name: N-[3-[[cyclohexyl(oxo)methyl]amino]-4-methylphenyl]-1-isoquinolinecarboxamide IUPAC Name: N-[3-(cyclohexanecarbonylamino)-4-methylphenyl]isoquinoline-1-carboxamide Traditional Name: N-[3-(cyclohexanecarbonylamino)-4-methyl-phenyl]isoquinoline-1-carboxamide Formula: C24H25N3O2 MolecularWeight: 387.4742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=NC=CC3=CC=CC=C32)NC(=O)C4CCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=NC=CC3=CC=CC=C32)NC(=O)C4CCCCC4

InChI

InChI=1S/C24H25N3O2/c1-16-11-12-19(15-21(16)27-23(28)18-8-3-2-4-9-18)26-24(29)22-20-10-6-5-7-17(20)13-14-25-22/h5-7,10-15,18H,2-4,8-9H2,1H3,(H,26,29)(H,27,28)