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4-[3-[3-methyl-4-(1,3-thiazol-2-ylcarbonyl)phenyl]prop-2-ynylamino]benzenecarboximidamide

4-[3-[3-methyl-4-(1,3-thiazol-2-ylcarbonyl)phenyl]prop-2-ynylamino]benzenecarboximidamide

Systemtic Name:4-[3-[3-methyl-4-(1,3-thiazol-2-ylcarbonyl)phenyl]prop-2-ynylamino]benzenecarboximidamide
Openeye Name:4-[3-[3-methyl-4-(thiazole-2-carbonyl)phenyl]prop-2-ynylamino]benzamidine
CAS Name:4-[3-[3-methyl-4-[oxo(2-thiazolyl)methyl]phenyl]prop-2-ynylamino]benzenecarboximidamide
IUPAC Name:4-[3-[3-methyl-4-(1,3-thiazole-2-carbonyl)phenyl]prop-2-ynylamino]benzenecarboximidamide
Traditional Name:4-[3-[3-methyl-4-(thiazole-2-carbonyl)phenyl]prop-2-ynylamino]benzamidine
Formula: C21H18N4OS
MolecularWeight: 374.45882
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C#CCNC2=CC=C(C=C2)C(=N)N)C(=O)C3=NC=CS3


Isomeric SMILES

CC1=C(C=CC(=C1)C#CCNC2=CC=C(C=C2)C(=N)N)C(=O)C3=NC=CS3


InChI

InChI=1S/C21H18N4OS/c1-14-13-15(4-9-18(14)19(26)21-25-11-12-27-21)3-2-10-24-17-7-5-16(6-8-17)20(22)23/h4-9,11-13,24H,10H2,1H3,(H3,22,23)


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