4-(3-bromanyl-4-cyclopentyloxy-5-methoxy-phenyl)-6-methyl-N-(phenylmethyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide

Systemtic Name: 4-(3-bromanyl-4-cyclopentyloxy-5-methoxy-phenyl)-6-methyl-N-(phenylmethyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: N-benzyl-4-[3-bromo-4-(cyclopentoxy)-5-methoxy-phenyl]-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: 4-(3-bromo-4-cyclopentyloxy-5-methoxyphenyl)-6-methyl-N-(phenylmethyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: N-benzyl-4-(3-bromo-4-cyclopentyloxy-5-methoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: N-benzyl-4-[3-bromo-4-(cyclopentoxy)-5-methoxy-phenyl]-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C25H28BrN3O3S MolecularWeight: 530.47712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)C2=CC(=C(C(=C2)Br)OC3CCCC3)OC)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(NC(=S)N1)C2=CC(=C(C(=C2)Br)OC3CCCC3)OC)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C25H28BrN3O3S/c1-15-21(24(30)27-14-16-8-4-3-5-9-16)22(29-25(33)28-15)17-12-19(26)23(20(13-17)31-2)32-18-10-6-7-11-18/h3-5,8-9,12-13,18,22H,6-7,10-11,14H2,1-2H3,(H,27,30)(H2,28,29,33)