4-azanyl-N5-[2-(cyclohexen-1-yl)ethyl]-N3-(phenylmethyl)-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N5-[2-(cyclohexen-1-yl)ethyl]-N3-(phenylmethyl)-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N3-benzyl-N5-[2-(cyclohexen-1-yl)ethyl]isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[2-(1-cyclohexenyl)ethyl]-N3-(phenylmethyl)isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-3-N-benzyl-5-N-[2-(cyclohexen-1-yl)ethyl]-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N-benzyl-N'-[2-(cyclohexen-1-yl)ethyl]isothiazole-3,5-dicarboxamide Formula: C20H24N4O2S MolecularWeight: 384.49516

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCNC(=O)C2=C(C(=NS2)C(=O)NCC3=CC=CC=C3)N

Isomeric SMILES

C1CCC(=CC1)CCNC(=O)C2=C(C(=NS2)C(=O)NCC3=CC=CC=C3)N

InChI

InChI=1S/C20H24N4O2S/c21-16-17(19(25)23-13-15-9-5-2-6-10-15)24-27-18(16)20(26)22-12-11-14-7-3-1-4-8-14/h2,5-7,9-10H,1,3-4,8,11-13,21H2,(H,22,26)(H,23,25)