N-[1-(cyclohexylamino)propyl]-4-(3-oxidanylidenethiochromeno[4,3-c]pyrazol-2-yl)benzamide

Systemtic Name: N-[1-(cyclohexylamino)propyl]-4-(3-oxidanylidenethiochromeno[4,3-c]pyrazol-2-yl)benzamide Openeye Name: N-[1-(cyclohexylamino)propyl]-4-(3-oxothiochromeno[4,3-c]pyrazol-2-yl)benzamide CAS Name: N-[1-(cyclohexylamino)propyl]-4-(3-oxo-2-thiochromeno[4,3-c]pyrazolyl)benzamide IUPAC Name: N-[1-(cyclohexylamino)propyl]-4-(3-oxothiochromeno[4,3-c]pyrazol-2-yl)benzamide Traditional Name: N-[1-(cyclohexylamino)propyl]-4-(3-ketothiochromeno[4,3-c]pyrazol-2-yl)benzamide Formula: C26H28N4O2S MolecularWeight: 460.59112

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Descriptors Computed from Structure

Canonical SMILES:

CCC(NC1CCCCC1)NC(=O)C2=CC=C(C=C2)N3C(=O)C4=CSC5=CC=CC=C5C4=N3

Isomeric SMILES

CCC(NC1CCCCC1)NC(=O)C2=CC=C(C=C2)N3C(=O)C4=CSC5=CC=CC=C5C4=N3

InChI

InChI=1S/C26H28N4O2S/c1-2-23(27-18-8-4-3-5-9-18)28-25(31)17-12-14-19(15-13-17)30-26(32)21-16-33-22-11-7-6-10-20(22)24(21)29-30/h6-7,10-16,18,23,27H,2-5,8-9H2,1H3,(H,28,31)