3-[3-[bis(azanyl)methylideneamino]oxypropoxy]-5-methyl-N-propyl-N-(thiophen-3-ylmethyl)benzamide

Systemtic Name: 3-[3-[bis(azanyl)methylideneamino]oxypropoxy]-5-methyl-N-propyl-N-(thiophen-3-ylmethyl)benzamide Openeye Name: 3-(3-guanidinooxypropoxy)-5-methyl-N-propyl-N-(3-thienylmethyl)benzamide CAS Name: 3-[3-(diaminomethylideneamino)oxypropoxy]-5-methyl-N-propyl-N-(3-thiophenylmethyl)benzamide IUPAC Name: 3-[3-(diaminomethylideneamino)oxypropoxy]-5-methyl-N-propyl-N-(thiophen-3-ylmethyl)benzamide Traditional Name: 3-(3-guanidinooxypropoxy)-5-methyl-N-propyl-N-(3-thenyl)benzamide Formula: C20H28N4O3S MolecularWeight: 404.52632

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CSC=C1)C(=O)C2=CC(=CC(=C2)OCCCON=C(N)N)C

Isomeric SMILES

CCCN(CC1=CSC=C1)C(=O)C2=CC(=CC(=C2)OCCCON=C(N)N)C

InChI

InChI=1S/C20H28N4O3S/c1-3-6-24(13-16-5-9-28-14-16)19(25)17-10-15(2)11-18(12-17)26-7-4-8-27-23-20(21)22/h5,9-12,14H,3-4,6-8,13H2,1-2H3,(H4,21,22,23)