3-methyl-N-[4-methylsulfanyl-1-oxidanylidene-1-[4-(oxolan-2-ylmethyl)-1,4-diazepan-1-yl]butan-2-yl]benzamide

Systemtic Name: 3-methyl-N-[4-methylsulfanyl-1-oxidanylidene-1-[4-(oxolan-2-ylmethyl)-1,4-diazepan-1-yl]butan-2-yl]benzamide Openeye Name: 3-methyl-N-[3-methylsulfanyl-1-[4-(tetrahydrofuran-2-ylmethyl)-1,4-diazepane-1-carbonyl]propyl]benzamide CAS Name: 3-methyl-N-[4-(methylthio)-1-oxo-1-[4-(2-oxolanylmethyl)-1,4-diazepan-1-yl]butan-2-yl]benzamide IUPAC Name: 3-methyl-N-[4-methylsulfanyl-1-oxo-1-[4-(oxolan-2-ylmethyl)-1,4-diazepan-1-yl]butan-2-yl]benzamide Traditional Name: 3-methyl-N-[3-(methylthio)-1-[4-(tetrahydrofurfuryl)-1,4-diazepane-1-carbonyl]propyl]benzamide Formula: C23H35N3O3S MolecularWeight: 433.6073

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(CCSC)C(=O)N2CCCN(CC2)CC3CCCO3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC(CCSC)C(=O)N2CCCN(CC2)CC3CCCO3

InChI

InChI=1S/C23H35N3O3S/c1-18-6-3-7-19(16-18)22(27)24-21(9-15-30-2)23(28)26-11-5-10-25(12-13-26)17-20-8-4-14-29-20/h3,6-7,16,20-21H,4-5,8-15,17H2,1-2H3,(H,24,27)