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2-(1,3-benzothiazol-2-yl)-5-methyl-4-[(pentylamino)methylidene]pyrazol-3-one

2-(1,3-benzothiazol-2-yl)-5-methyl-4-[(pentylamino)methylidene]pyrazol-3-one

Systemtic Name:2-(1,3-benzothiazol-2-yl)-5-methyl-4-[(pentylamino)methylidene]pyrazol-3-one
Openeye Name:2-(1,3-benzothiazol-2-yl)-5-methyl-4-[(pentylamino)methylene]pyrazol-3-one
CAS Name:2-(1,3-benzothiazol-2-yl)-5-methyl-4-[(pentylamino)methylidene]-3-pyrazolone
IUPAC Name:2-(1,3-benzothiazol-2-yl)-5-methyl-4-[(pentylamino)methylidene]pyrazol-3-one
Traditional Name:4-[(amylamino)methylene]-2-(1,3-benzothiazol-2-yl)-5-methyl-2-pyrazolin-3-one
Formula: C17H20N4OS
MolecularWeight: 328.4319
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC=C1C(=NN(C1=O)C2=NC3=CC=CC=C3S2)C


Isomeric SMILES

CCCCCNC=C1C(=NN(C1=O)C2=NC3=CC=CC=C3S2)C


InChI

InChI=1S/C17H20N4OS/c1-3-4-7-10-18-11-13-12(2)20-21(16(13)22)17-19-14-8-5-6-9-15(14)23-17/h5-6,8-9,11,18H,3-4,7,10H2,1-2H3


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