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

Systemtic Name: N-(cyclopropylmethyl)-3-[(3,4-dimethoxyphenyl)methylsulfanyl]-2-[(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)amino]propanamide Openeye Name: N-(cyclopropylmethyl)-3-[(3,4-dimethoxyphenyl)methylsulfanyl]-2-[(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)amino]propanamide CAS Name: N-(cyclopropylmethyl)-3-[(3,4-dimethoxyphenyl)methylthio]-2-[[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]amino]propanamide IUPAC Name: N-(cyclopropylmethyl)-3-[(3,4-dimethoxyphenyl)methylsulfanyl]-2-[(2-imidazol-1-yl-6-methylpyrimidin-4-yl)amino]propanamide Traditional Name: N-(cyclopropylmethyl)-2-[(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)amino]-3-(veratrylthio)propionamide Formula: C24H30N6O3S MolecularWeight: 482.5984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C=CN=C2)NC(CSCC3=CC(=C(C=C3)OC)OC)C(=O)NCC4CC4

Isomeric SMILES

CC1=CC(=NC(=N1)N2C=CN=C2)NC(CSCC3=CC(=C(C=C3)OC)OC)C(=O)NCC4CC4

InChI

InChI=1S/C24H30N6O3S/c1-16-10-22(29-24(27-16)30-9-8-25-15-30)28-19(23(31)26-12-17-4-5-17)14-34-13-18-6-7-20(32-2)21(11-18)33-3/h6-11,15,17,19H,4-5,12-14H2,1-3H3,(H,26,31)(H,27,28,29)