N-(cyclopropylmethyl)-2-[(3,4-dimethylphenyl)-[(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)amino]methyl]sulfanyl-propanamide

Systemtic Name: N-(cyclopropylmethyl)-2-[(3,4-dimethylphenyl)-[(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)amino]methyl]sulfanyl-propanamide Openeye Name: N-(cyclopropylmethyl)-2-[(3,4-dimethylphenyl)-[(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)amino]methyl]sulfanyl-propanamide CAS Name: N-(cyclopropylmethyl)-2-[[(3,4-dimethylphenyl)-[[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]amino]methyl]thio]propanamide IUPAC Name: N-(cyclopropylmethyl)-2-[(3,4-dimethylphenyl)-[(2-imidazol-1-yl-6-methylpyrimidin-4-yl)amino]methyl]sulfanylpropanamide Traditional Name: N-(cyclopropylmethyl)-2-[[(3,4-dimethylphenyl)-[(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)amino]methyl]thio]propionamide Formula: C24H30N6OS MolecularWeight: 450.5996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(NC2=NC(=NC(=C2)C)N3C=CN=C3)SC(C)C(=O)NCC4CC4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(NC2=NC(=NC(=C2)C)N3C=CN=C3)SC(C)C(=O)NCC4CC4)C

InChI

InChI=1S/C24H30N6OS/c1-15-5-8-20(11-16(15)2)23(32-18(4)22(31)26-13-19-6-7-19)28-21-12-17(3)27-24(29-21)30-10-9-25-14-30/h5,8-12,14,18-19,23H,6-7,13H2,1-4H3,(H,26,31)(H,27,28,29)