4-azanyl-N3-[(3-methoxyphenyl)methyl]-N5-(3-methylbutyl)-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N3-[(3-methoxyphenyl)methyl]-N5-(3-methylbutyl)-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-isopentyl-N3-[(3-methoxyphenyl)methyl]isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N3-[(3-methoxyphenyl)methyl]-N5-(3-methylbutyl)isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-3-N-[(3-methoxyphenyl)methyl]-5-N-(3-methylbutyl)-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-isoamyl-N-m-anisyl-isothiazole-3,5-dicarboxamide Formula: C18H24N4O3S MolecularWeight: 376.47316

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=C(C(=NS1)C(=O)NCC2=CC(=CC=C2)OC)N

Isomeric SMILES

CC(C)CCNC(=O)C1=C(C(=NS1)C(=O)NCC2=CC(=CC=C2)OC)N

InChI

InChI=1S/C18H24N4O3S/c1-11(2)7-8-20-18(24)16-14(19)15(22-26-16)17(23)21-10-12-5-4-6-13(9-12)25-3/h4-6,9,11H,7-8,10,19H2,1-3H3,(H,20,24)(H,21,23)