N-[3-[[3-azanylpropyl(cyclopropylcarbonyl)amino]methyl]phenyl]-4-methyl-1,2,3-thiadiazole-5-carboxamide

Systemtic Name: N-[3-[[3-azanylpropyl(cyclopropylcarbonyl)amino]methyl]phenyl]-4-methyl-1,2,3-thiadiazole-5-carboxamide Openeye Name: N-[3-[[3-aminopropyl(cyclopropanecarbonyl)amino]methyl]phenyl]-4-methyl-thiadiazole-5-carboxamide CAS Name: N-[3-[[3-aminopropyl-[cyclopropyl(oxo)methyl]amino]methyl]phenyl]-4-methyl-5-thiadiazolecarboxamide IUPAC Name: N-[3-[[3-aminopropyl(cyclopropanecarbonyl)amino]methyl]phenyl]-4-methylthiadiazole-5-carboxamide Traditional Name: N-[3-[[3-aminopropyl(cyclopropanecarbonyl)amino]methyl]phenyl]-4-methyl-thiadiazole-5-carboxamide Formula: C18H23N5O2S MolecularWeight: 373.47252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SN=N1)C(=O)NC2=CC=CC(=C2)CN(CCCN)C(=O)C3CC3

Isomeric SMILES

CC1=C(SN=N1)C(=O)NC2=CC=CC(=C2)CN(CCCN)C(=O)C3CC3

InChI

InChI=1S/C18H23N5O2S/c1-12-16(26-22-21-12)17(24)20-15-5-2-4-13(10-15)11-23(9-3-8-19)18(25)14-6-7-14/h2,4-5,10,14H,3,6-9,11,19H2,1H3,(H,20,24)