N-(1,3-benzothiazol-2-yl)-4-(N'-propan-2-ylcarbamimidoyl)benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-4-(N'-propan-2-ylcarbamimidoyl)benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-(N'-isopropylcarbamimidoyl)benzamide CAS Name: 4-[amino(propan-2-ylimino)methyl]-N-(1,3-benzothiazol-2-yl)benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-(N'-propan-2-ylcarbamimidoyl)benzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-(N'-isopropylamidino)benzamide Formula: C18H18N4OS MolecularWeight: 338.42672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N=C(C1=CC=C(C=C1)C(=O)NC2=NC3=CC=CC=C3S2)N

Isomeric SMILES

CC(C)N=C(C1=CC=C(C=C1)C(=O)NC2=NC3=CC=CC=C3S2)N

InChI

InChI=1S/C18H18N4OS/c1-11(2)20-16(19)12-7-9-13(10-8-12)17(23)22-18-21-14-5-3-4-6-15(14)24-18/h3-11H,1-2H3,(H2,19,20)(H,21,22,23)