N-[6-(aminocarbonylamino)-1-(4-aminophenyl)-2-oxidanylidene-hexan-3-yl]-2-azanyl-3-methyl-butanamide

Systemtic Name: N-[6-(aminocarbonylamino)-1-(4-aminophenyl)-2-oxidanylidene-hexan-3-yl]-2-azanyl-3-methyl-butanamide Openeye Name: 2-amino-N-[1-[2-(4-aminophenyl)acetyl]-4-ureido-butyl]-3-methyl-butanamide CAS Name: 2-amino-N-[1-(4-aminophenyl)-6-(carbamoylamino)-2-oxohexan-3-yl]-3-methylbutanamide IUPAC Name: 2-amino-N-[1-(4-aminophenyl)-6-(carbamoylamino)-2-oxohexan-3-yl]-3-methylbutanamide Traditional Name: 2-amino-N-[1-[2-(4-aminophenyl)acetyl]-4-ureido-butyl]-3-methyl-butyramide Formula: C18H29N5O3 MolecularWeight: 363.45456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(CCCNC(=O)N)C(=O)CC1=CC=C(C=C1)N)N

Isomeric SMILES

CC(C)C(C(=O)NC(CCCNC(=O)N)C(=O)CC1=CC=C(C=C1)N)N

InChI

InChI=1S/C18H29N5O3/c1-11(2)16(20)17(25)23-14(4-3-9-22-18(21)26)15(24)10-12-5-7-13(19)8-6-12/h5-8,11,14,16H,3-4,9-10,19-20H2,1-2H3,(H,23,25)(H3,21,22,26)